[tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate

C17H37NO3Si2 — CID 553383

IUPAC[tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate
SMILESCC(C)(C)[Si](C)(C)OC(=O)C1CC(O[Si](C)(C)C(C)(C)C)CN1
InChIInChI=1S/C17H37NO3Si2/c1-16(2,3)22(7,8)20-13-11-14(18-12-13)15(19)21-23(9,10)17(4,5)6/h13-14,18H,11-12H2,1-10H3
InChIKeyURVLKPPZBSIWKE-UHFFFAOYSA-N
MW359.66 g/mol
LogP4.29
Rot. Bonds4

About [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate

[tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate (PubChem CID 553383) has the molecular formula C17H37NO3Si2 and a molecular weight of 359.66 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate
PubChem CID553383
Molecular FormulaC17H37NO3Si2
Molecular Weight359.66 g/mol
Exact Mass359.23
IUPAC Name[tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate
SMILESCC(C)(C)[Si](C)(C)OC(=O)C1CC(O[Si](C)(C)C(C)(C)C)CN1
InChIInChI=1S/C17H37NO3Si2/c1-16(2,3)22(7,8)20-13-11-14(18-12-13)15(19)21-23(9,10)17(4,5)6/h13-14,18H,11-12H2,1-10H3
InChIKeyURVLKPPZBSIWKE-UHFFFAOYSA-N
XLogP4.29
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.66
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate?
The IUPAC name of [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate (CID 553383) is [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate.
What is the SMILES notation for [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate?
The canonical SMILES for [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate is CC(C)(C)[Si](C)(C)OC(=O)C1CC(O[Si](C)(C)C(C)(C)C)CN1.
What is the InChIKey of [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate?
The InChIKey is URVLKPPZBSIWKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37NO3Si2/c1-16(2,3)22(7,8)20-13-11-14(18-12-13)15(19)21-23(9,10)17(4,5)6/h13-14,18H,11-12H2,1-10H3.
What are the key properties of [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate?
[tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate has a molecular weight of 359.66 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl] 4-[tert-butyl(dimethyl)silyl]oxypyrrolidine-2-carboxylate is sourced from PubChem (CID 553383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).